HuagongsheHuagongshe Chemistry Print Report · For research reference only
6-Phenethyl-piperazin-2-one
Identifiers & Physical Properties
| CAS No. | 907973-30-2 |
|---|---|
| Molecular formula | C12H16N2O |
| Average molar mass | 204.27 g/mol |
| Monoisotopic mass | 204.12626314 g/mol |
| SMILES | O=C1CNCC(CCc2ccccc2)N1 |
| InChIKey | MVAFDZAJCKZTAX-UHFFFAOYSA-N |
| PubChem CID | 69088317 |
| DTXSID | DTXSID301301644 |
Chemical & Physical Properties
| XLogP | 1.3 |
|---|---|
| Topological polar surface area | 41.1 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 212 |